Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UTS2R | Q9UKP6 | 5/20 | 0.60 |
| ▸ | TACR3 | P29371 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.56 |
| ▸ | CTSG | P08311 | 3/20 | 0.56 |
| ▸ | CTRB1 | P17538 | 3/20 | 0.56 |
| ▸ | CMA1 | P23946 | 3/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | PRKACA | P17612 | 1/20 | 0.52 |
| ▸ | CDK8 | P49336 | 1/20 | 0.52 |
| ▸ | GSK3A | P49840 | 1/20 | 0.52 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6607705 | 0.90 | UTS2R (0.58) | UTS2RTACR3CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL15093398 | 0.85 | POLB (0.56) | TACR3TSHRALDH1A1POLBKDM4E | |
| SCHEMBL894067 | 0.85 | POLB (0.56) | TACR3TSHRALDH1A1POLBKDM4E | |
| SCHEMBL9571851 | 0.84 | UTS2R (0.60) | UTS2RMEN1KMT2A | |
| SCHEMBL29138702 | 0.84 | ALDH1A1 (0.56) | TACR3ALDH1A1POLBKMT2ANAAA | |
| SCHEMBL4660820 | 0.83 | KDM4E (0.67) | UTS2RTACR3TSHRALDH1A1KDM4E | |
| SCHEMBL4659439 | 0.83 | KDM4E (0.67) | UTS2RTACR3TSHRALDH1A1KDM4E | |
| SCHEMBL5642916 | 0.83 | KDM4E (0.67) | UTS2RTACR3TSHRALDH1A1KDM4E | |
| SCHEMBL9403960 | 0.83 | UTS2R (0.55) | UTS2RKDM4EGAAMEN1KMT2A | |
| SCHEMBL22117115 | 0.83 | UTS2R (0.55) | UTS2RKDM4EGAAMEN1KMT2A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1049691-B1 | SUBSTITUTED 5-(2,2-DIFLUORO-1,3-BENZODIOXOL-5-YL) CYCLOPENTENOPYRIDINE DERIVATIVE | BANYU PHARMA CO LTD (JP) | 2004-02-18 | — | — | EP | disclosed |
| US-6413979-B1 | ANTAGONISTS TO ENDOTHELINS; VASODILATORS AND BRONCHODILATORS; SYNTHESIS ROUTES; HYPERTENSION, ASTHMA, RAYNAUD'S DISEASE, RENAL AND HEART FAILURE, ANGINA, DIABETES, CEREBRAL INFARC-TION AND VASOSPASM, ARTERIOSCLEROSIS, RESTENOSIS, PROSTATISM | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2002-07-02 | — | — | US | disclosed |